Basic information
- CAS
53907-75-8- Standard SMILES
CCCCCC1(C)CO1- InChIKey
SMSAOBIPMBKJOU-UHFFFAOYSA-N- Molecular formula
- C8H16O
- Average molar mass
- 128.21 g/mol
- Monoisotopic mass
- 128.12011513
Names & identifiers
- Preferred name
- 2-Methyl-2-pentyloxirane
- IUPAC
- 2-methyl-2-pentyloxirane
- English name
- 2-Pentyl-2-methyloxirane
- Molecular formula
- C8H16O
- Molecular weight
- 128.21
Names & synonyms
2-Methyl-2-pentyloxiraneOxirane, 2-methyl-2-pentyl-53907-75-8DTXSID00968696RefChem:263146DTXCID601396266SMSAOBIPMBKJOU-UHFFFAOYSA-N2-methyl-1,2-epoxyheptane2-amyl-2-methyl-oxirane2-methyl-1-heptene oxide2-methyl-2-pentyl-oxiraneSCHEMBL2764900
Show more names
2-Pentyl-2-methyloxirane2ξ-Methyl-2-pentyloxirane1,2-Epoxy-2-methylheptane
rac-2-methyl-1,2-epoxyheptane(+/-)-2-methyl-1,2-epoxyheptaneAKOS015905431DA-25924
Database identifiers
- CAS
53907-75-8- PubChem CID
- 559073
- DTXSID
DTXSID00968696- Nikkaji
- J108.750I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 90.6
Physicochemical properties
- Boiling point
- 152 °C · 152 °C
- Density
- 0.855 · 0.855±0.06 g/cm3(Predicted)
Related reactions
8 records
Compound notes
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